Home Aldehydes 2,3,4,5-Tetrafluorobenzaldehyde

2,3,4,5-Tetrafluorobenzaldehyde

CAS No.:
16583-06-5
Catalog Number:
AG003FDH
Molecular Formula:
C7H2F4O
Molecular Weight:
178.0838
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Purity
Availability
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Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$404
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Product Description
Catalog Number:
AG003FDH
Chemical Name:
2,3,4,5-Tetrafluorobenzaldehyde
CAS Number:
16583-06-5
Molecular Formula:
C7H2F4O
Molecular Weight:
178.0838
MDL Number:
MFCD02683041
IUPAC Name:
2,3,4,5-tetrafluorobenzaldehyde
InChI:
InChI=1S/C7H2F4O/c8-4-1-3(2-12)5(9)7(11)6(4)10/h1-2H
InChI Key:
UPJHEKIKCNDMEX-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)c(c(c1F)F)F
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.086g/mol
Monoisotopic Mass:
178.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
N-[(4-Carbamoylphen-yl)carbamothio-yl]-2,3,4,5-tetra-fluoro-benzamide. Acta crystallographica. Section E, Structure reports online 20110301
Properties